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{
"id": "mp-1183652",
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{
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"structure_string": "Al22 N2 O34\n1.0\n2.827440 -4.897269 0.000000\n2.827440 4.897269 0.000000\n0.000000 0.000000 23.021542\nAl N O\n22 2 34\ndirect\n0.167336 0.334671 0.606196 Al\n0.832664 0.665329 0.393804 Al\n0.665329 0.832664 0.606196 Al\n0.832664 0.665329 0.106196 Al\n0.334671 0.167336 0.393804 Al\n0.167336 0.334671 0.893804 Al\n0.167336 0.832664 0.606196 Al\n0.334671 0.167336 0.106196 Al\n0.832664 0.167336 0.393804 Al\n0.665329 0.832664 0.893804 Al\n0.832664 0.167336 0.106196 Al\n0.167336 0.832664 0.893804 Al\n0.333333 0.666667 0.174714 Al\n0.666667 0.333333 0.825286 Al\n0.666667 0.333333 0.674714 Al\n0.333333 0.666667 0.325286 Al\n0.333333 0.666667 0.024587 Al\n0.666667 0.333333 0.975413 Al\n0.666667 0.333333 0.524587 Al\n0.333333 0.666667 0.475413 Al\n0.000000 0.000000 0.000000 Al\n0.000000 0.000000 0.500000 Al\n0.333333 0.666667 0.750000 N\n0.666667 0.333333 0.250000 N\n0.500137 0.000275 0.143538 O\n0.499863 0.999725 0.856462 O\n0.999725 0.499863 0.143538 O\n0.499863 0.999725 0.643538 O\n0.000275 0.500137 0.856462 O\n0.500137 0.000275 0.356462 O\n0.500137 0.499863 0.143538 O\n0.000275 0.500137 0.643538 O\n0.499863 0.500137 0.856462 O\n0.999725 0.499863 0.356462 O\n0.499863 0.500137 0.643538 O\n0.500137 0.499863 0.356462 O\n0.157151 0.314303 0.049130 O\n0.842849 0.685697 0.950870 O\n0.685697 0.842849 0.049130 O\n0.842849 0.685697 0.549130 O\n0.314303 0.157151 0.950870 O\n0.157151 0.314303 0.450870 O\n0.157151 0.842849 0.049130 O\n0.314303 0.157151 0.549130 O\n0.842849 0.157151 0.950870 O\n0.685697 0.842849 0.450870 O\n0.842849 0.157151 0.549130 O\n0.157151 0.842849 0.450870 O\n0.333333 0.666667 0.555301 O\n0.666667 0.333333 0.444699 O\n0.666667 0.333333 0.055301 O\n0.333333 0.666667 0.944699 O\n0.333333 0.666667 0.250000 O\n0.666667 0.333333 0.750000 O\n0.000000 0.000000 0.139951 O\n0.000000 0.000000 0.860049 O\n0.000000 0.000000 0.639951 O\n0.000000 0.000000 0.360049 O\n",
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{
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{
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"structure_string": "Mg12 O12\n1.0\n1.499301 -2.596866 0.000000\n1.499301 2.596866 0.000000\n0.000000 0.000000 29.818685\nMg O\n12 12\ndirect\n0.333333 0.666667 0.834994 Mg\n0.666667 0.333333 0.165006 Mg\n0.666667 0.333333 0.334994 Mg\n0.333333 0.666667 0.665006 Mg\n0.333333 0.666667 0.417485 Mg\n0.666667 0.333333 0.582515 Mg\n0.666667 0.333333 0.917485 Mg\n0.333333 0.666667 0.082515 Mg\n0.000000 0.000000 0.250000 Mg\n0.000000 0.000000 0.750000 Mg\n0.000000 0.000000 0.000000 Mg\n0.000000 0.000000 0.500000 Mg\n0.333333 0.666667 0.958738 O\n0.666667 0.333333 0.041262 O\n0.666667 0.333333 0.458738 O\n0.333333 0.666667 0.541262 O\n0.333333 0.666667 0.206130 O\n0.666667 0.333333 0.793870 O\n0.666667 0.333333 0.706130 O\n0.333333 0.666667 0.293870 O\n0.000000 0.000000 0.123770 O\n0.000000 0.000000 0.876230 O\n0.000000 0.000000 0.623770 O\n0.000000 0.000000 0.376230 O\n",
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{
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{
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{
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"energy_uncorrected": -28.24162352,
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"updated_at": "2021-11-28T01:37:28.652000Z",
"spacegroup": 194
}
]
}